N-(2,5-dimethylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethylphenyl)propanamide CAS Name: N-(2,5-dimethylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(2,5-dimethylphenyl)propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NN=C(N2CC=C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NN=C(N2CC=C)C

InChI

InChI=1S/C17H22N4OS/c1-6-9-21-14(5)19-20-17(21)23-13(4)16(22)18-15-10-11(2)7-8-12(15)3/h6-8,10,13H,1,9H2,2-5H3,(H,18,22)